methyl 5-[3-[(2-oxidanyl-3-phenoxy-propyl)amino]propyl]thiophene-2-carboxylate

Systemtic Name: methyl 5-[3-[(2-oxidanyl-3-phenoxy-propyl)amino]propyl]thiophene-2-carboxylate Openeye Name: methyl 5-[3-[(2-hydroxy-3-phenoxy-propyl)amino]propyl]thiophene-2-carboxylate CAS Name: 5-[3-[(2-hydroxy-3-phenoxypropyl)amino]propyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[3-[(2-hydroxy-3-phenoxypropyl)amino]propyl]thiophene-2-carboxylate Traditional Name: 5-[3-[(2-hydroxy-3-phenoxy-propyl)amino]propyl]thiophene-2-carboxylic acid methyl ester Formula: C18H23NO4S MolecularWeight: 349.44452

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(S1)CCCNCC(COC2=CC=CC=C2)O

Isomeric SMILES

COC(=O)C1=CC=C(S1)CCCNCC(COC2=CC=CC=C2)O

InChI

InChI=1S/C18H23NO4S/c1-22-18(21)17-10-9-16(24-17)8-5-11-19-12-14(20)13-23-15-6-3-2-4-7-15/h2-4,6-7,9-10,14,19-20H,5,8,11-13H2,1H3